 |
 |
 |
Calculating band structures and density of states with DFTB+ |
 |
Calculating band structures and density of states with DFTB+
Bálint Aradi
Date: September 21, 2007
Abstract:
This document demonstrates on the example of GaAs how the band
structure and the density of states (DOS) of periodic systems
(wires, surfaces, solids) can be obtained using DFTB+.